N-(4-butylphenyl)-2-[3-(2-methylpropyl)-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-butylphenyl)-2-[3-(2-methylpropyl)-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-butylphenyl)-2-[3-isobutyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(4-butylphenyl)-2-[[3-(2-methylpropyl)-4-oxo-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: N-(4-butylphenyl)-2-[3-(2-methylpropyl)-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(4-butylphenyl)-2-[[3-isobutyl-4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetamide Formula: C26H29N3O2S3 MolecularWeight: 511.72236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC(C)C

InChI

InChI=1S/C26H29N3O2S3/c1-4-5-7-18-9-11-19(12-10-18)27-22(30)16-34-26-28-24-23(25(31)29(26)14-17(2)3)20(15-33-24)21-8-6-13-32-21/h6,8-13,15,17H,4-5,7,14,16H2,1-3H3,(H,27,30)